1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol

C9H18N2O3S — CID 114383287

IUPAC1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol
SMILESO=S(=O)(NCC1(O)CCCC1)NC1CC1
InChIInChI=1S/C9H18N2O3S/c12-9(5-1-2-6-9)7-10-15(13,14)11-8-3-4-8/h8,10-12H,1-7H2
InChIKeyQELMGLXKZJSEQD-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.12
Rot. Bonds5

About 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol

1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol (PubChem CID 114383287) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol
PubChem CID114383287
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC Name1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol
SMILESO=S(=O)(NCC1(O)CCCC1)NC1CC1
InChIInChI=1S/C9H18N2O3S/c12-9(5-1-2-6-9)7-10-15(13,14)11-8-3-4-8/h8,10-12H,1-7H2
InChIKeyQELMGLXKZJSEQD-UHFFFAOYSA-N
XLogP-0.12
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol (CID 114383287) is 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol is O=S(=O)(NCC1(O)CCCC1)NC1CC1.
What is the InChIKey of 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol?
The InChIKey is QELMGLXKZJSEQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c12-9(5-1-2-6-9)7-10-15(13,14)11-8-3-4-8/h8,10-12H,1-7H2.
What are the key properties of 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol?
1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol has a molecular weight of 234.32 g/mol, XLogP of -0.12, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 114383287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).